N-(4-bromanyl-2-fluoranyl-phenyl)-2-fluoranyl-5-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-fluoranyl-5-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-fluoro-5-[3-methyl-4-(p-tolyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-fluoro-5-[[3-methyl-4-(4-methylphenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-fluoro-5-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-fluoro-5-[3-methyl-4-(p-tolyl)piperazino]sulfonyl-benzamide Formula: C25H24BrF2N3O3S MolecularWeight: 564.442166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C25H24BrF2N3O3S/c1-16-3-6-19(7-4-16)31-12-11-30(15-17(31)2)35(33,34)20-8-9-22(27)21(14-20)25(32)29-24-10-5-18(26)13-23(24)28/h3-10,13-14,17H,11-12,15H2,1-2H3,(H,29,32)